N-[(1S)-1-[5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl]-7-oxidanylidene-octyl]-1-methyl-piperidine-4-carboxamide

Systemtic Name: N-[(1S)-1-[5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl]-7-oxidanylidene-octyl]-1-methyl-piperidine-4-carboxamide Openeye Name: N-[(1S)-1-[5-(4-methoxy-2-quinolyl)-1H-imidazol-2-yl]-7-oxo-octyl]-1-methyl-piperidine-4-carboxamide CAS Name: N-[(1S)-1-[5-(4-methoxy-2-quinolinyl)-1H-imidazol-2-yl]-7-oxooctyl]-1-methyl-4-piperidinecarboxamide IUPAC Name: N-[(1S)-1-[5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl]-7-oxooctyl]-1-methylpiperidine-4-carboxamide Traditional Name: N-[(1S)-7-keto-1-[5-(4-methoxy-2-quinolyl)-1H-imidazol-2-yl]octyl]-1-methyl-isonipecotamide Formula: C28H37N5O3 MolecularWeight: 491.62508

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCCC(C1=NC=C(N1)C2=NC3=CC=CC=C3C(=C2)OC)NC(=O)C4CCN(CC4)C

Isomeric SMILES

CC(=O)CCCCC[C@@H](C1=NC=C(N1)C2=NC3=CC=CC=C3C(=C2)OC)NC(=O)C4CCN(CC4)C

InChI

InChI=1S/C28H37N5O3/c1-19(34)9-5-4-6-12-23(32-28(35)20-13-15-33(2)16-14-20)27-29-18-25(31-27)24-17-26(36-3)21-10-7-8-11-22(21)30-24/h7-8,10-11,17-18,20,23H,4-6,9,12-16H2,1-3H3,(H,29,31)(H,32,35)/t23-/m0/s1